REMARK  Name = BDB024566
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.367  -0.732  -0.046  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        4.369   0.102   0.488  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        4.769   1.386   1.101  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        4.855   2.495   0.045  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        3.877   1.759   2.282  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        2.434   1.865   1.846  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        2.012   0.655   1.062  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        0.632   0.363   0.947  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -0.433   1.047   1.465  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1       -1.524   0.408   1.083  0.00  0.00    +0.115 A 
ATOM     11  N   LIG    1       -1.192  -0.718   0.347  0.00  0.00    -0.323 N 
ATOM     12  C   LIG    1        0.194  -0.735   0.229  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        1.087  -1.581  -0.427  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.454  -1.281  -0.324  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        2.950  -0.188   0.406  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        5.218  -1.856  -0.512  0.00  0.00    -0.226 OA
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1       -2.040  -1.736  -0.266  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -3.198  -2.279   0.592  0.00  0.00    +0.106 C 
ATOM     19  N   LIG    1       -3.914  -3.388  -0.062  0.00  0.00    -0.314 NA
ATOM     20  H   LIG    1       -3.277  -4.175  -0.195  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1       -4.439  -2.967  -1.365  0.00  0.00    +0.081 C 
ATOM     22  C   LIG    1       -3.332  -2.476  -2.298  0.00  0.00    +0.017 C 
ATOM     23  C   LIG    1       -2.523  -1.342  -1.668  0.00  0.00    +0.027 C 
ENDBRANCH  11  17
BRANCH   1  25
ATOM     24  C   LIG    1        7.666  -0.957  -0.520  0.00  0.00    +0.282 C 
ATOM     25  O   LIG    1        6.609  -0.154   0.007  0.00  0.00    -0.453 OA
ENDBRANCH   1  25
BRANCH  10  26
ATOM     26  C   LIG    1       -2.895   0.902   1.443  0.00  0.00    +0.109 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -3.694   1.470   0.292  0.00  0.00    -0.040 A 
ATOM     28  C   LIG    1       -3.124   2.398  -0.593  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -3.873   2.933  -1.643  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.204   2.559  -1.812  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -5.790   1.657  -0.926  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -5.043   1.121   0.124  0.00  0.00    +0.004 A 
ENDBRANCH  26  27
ENDBRANCH  10  26
TORSDOF 4